ChemSpider 2D Image | 6-Chloro-2-methyl-N-[4-(3-methyl-1-piperidinyl)butyl]-3-quinolinecarboxamide | C21H28ClN3O

6-Chloro-2-methyl-N-[4-(3-methyl-1-piperidinyl)butyl]-3-quinolinecarboxamide

  • Molecular FormulaC21H28ClN3O
  • Average mass373.919 Da
  • Monoisotopic mass373.192078 Da
  • ChemSpider ID30508935

More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

3-Quinolinecarboxamide, 6-chloro-2-methyl-N-[4-(3-methyl-1-piperidinyl)butyl]- [ACD/Index Name]
6-Chlor-2-methyl-N-[4-(3-methyl-1-piperidinyl)butyl]-3-chinolincarboxamid [German] [ACD/IUPAC Name]
6-Chloro-2-méthyl-N-[4-(3-méthyl-1-pipéridinyl)butyl]-3-quinoléinecarboxamide [French] [ACD/IUPAC Name]
6-Chloro-2-methyl-N-[4-(3-methyl-1-piperidinyl)butyl]-3-quinolinecarboxamide [ACD/IUPAC Name]
6-CHLORO-2-METHYL-N-[4-(3-METHYLPIPERIDIN-1-YL)BUTYL]QUINOLINE-3-CARBOXAMIDE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 543.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.2±3.0 kJ/mol
Flash Point: 282.6±30.1 °C
Index of Refraction: 1.577
Molar Refractivity: 108.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.68
ACD/LogD (pH 5.5): 1.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.67
ACD/LogD (pH 7.4): 2.11
ACD/BCF (pH 7.4): 6.84
ACD/KOC (pH 7.4): 31.94
Polar Surface Area: 45 Å2
Polarizability: 43.1±0.5 10-24cm3
Surface Tension: 44.6±3.0 dyne/cm
Molar Volume: 328.4±3.0 cm3

Click to predict properties on the Chemicalize site






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